4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide

C13H15N5O — CID 62241386

IUPAC4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide
SMILESCC(NC(=O)c1cc(NN)ccn1)c1ccccn1
InChIInChI=1S/C13H15N5O/c1-9(11-4-2-3-6-15-11)17-13(19)12-8-10(18-14)5-7-16-12/h2-9H,14H2,1H3,(H,16,18)(H,17,19)
InChIKeyOORBDWMNKMRLGS-UHFFFAOYSA-N
MW257.30 g/mol
LogP1.25
Rot. Bonds4

About 4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide

4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide (PubChem CID 62241386) has the molecular formula C13H15N5O and a molecular weight of 257.30 g/mol. Its IUPAC name is 4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide
PubChem CID62241386
Molecular FormulaC13H15N5O
Molecular Weight257.30 g/mol
Exact Mass257.13
IUPAC Name4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide
SMILESCC(NC(=O)c1cc(NN)ccn1)c1ccccn1
InChIInChI=1S/C13H15N5O/c1-9(11-4-2-3-6-15-11)17-13(19)12-8-10(18-14)5-7-16-12/h2-9H,14H2,1H3,(H,16,18)(H,17,19)
InChIKeyOORBDWMNKMRLGS-UHFFFAOYSA-N
XLogP1.25
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide?
The IUPAC name of 4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide (CID 62241386) is 4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide?
The canonical SMILES for 4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide is CC(NC(=O)c1cc(NN)ccn1)c1ccccn1.
What is the InChIKey of 4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide?
The InChIKey is OORBDWMNKMRLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O/c1-9(11-4-2-3-6-15-11)17-13(19)12-8-10(18-14)5-7-16-12/h2-9H,14H2,1H3,(H,16,18)(H,17,19).
What are the key properties of 4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide?
4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide has a molecular weight of 257.30 g/mol, XLogP of 1.25, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62241386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).